input word = C00060259

Metabolite InformationStructural formula
Name (3beta,12beta)-3-[[6-O-Acetyl-2-O-(6-O-acetyl-beta-D-glucopyranosyl)-beta-D-glucopyranosyl]oxy]-12-hydroxydammar-24-en-20-yl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
Formula C58H96O25
Mw 1192.62406862
CAS RN 1646595-48-3
C_ID C00060259
InChIKey HRUIFVUXBZHKGJ-ADZKRXCWSA-N
InChICode InChI=1S/C58H96O25/c1-25(2)12-11-16-58(10,83-52-48(73)44(69)40(65)33(79-52)24-76-50-46(71)42(67)38(63)30(21-59)77-50)28-13-18-57(9)37(28)29(62)20-35-55(7)17-15-36(54(5,6)34(55)14-19-56(35,57)8)81-53-49(45(70)41(66)32(80-53)23-75-27(4)61)82-51-47(72)43(68)39(64)31(78-51)22-74-26(3)60/h12,28-53,59,62-73H,11,13-24H2,1-10H3/t28-,29+,30+,31+,32+,33+,34-,35+,36-,37-,38+,39+,40+,41+,42-,43-,44-,45-,46+,47+,48+,49+,50+,51-,52-,53-,55-,56+,57+,58-/m0/s1
SMILES CC(=O)OCC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC(O)C4C(C(C)(CCC=C(C)C)OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6O)CCC45C)C3(C)C)OC(COC(C)=O)C(O)C2O)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng Ref.
zoom in



OrganismPanax ginseng
Referencehttps://doi.org/10.1016/j.jpba.2014.12.005